5-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfonyl-2-methoxy-benzoic acid

Systemtic Name: 5-[2-[ethyl(methyl)amino]-2-oxidanylidene-ethyl]sulfonyl-2-methoxy-benzoic acid Openeye Name: 5-[2-[ethyl(methyl)amino]-2-oxo-ethyl]sulfonyl-2-methoxy-benzoic acid CAS Name: 5-[2-[ethyl(methyl)amino]-2-oxoethyl]sulfonyl-2-methoxybenzoic acid IUPAC Name: 5-[2-[ethyl(methyl)amino]-2-oxoethyl]sulfonyl-2-methoxybenzoic acid Traditional Name: 5-[2-[ethyl(methyl)amino]-2-keto-ethyl]sulfonyl-2-methoxy-benzoic acid Formula: C13H17NO6S MolecularWeight: 315.34218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)CS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

Isomeric SMILES

CCN(C)C(=O)CS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)O

InChI

InChI=1S/C13H17NO6S/c1-4-14(2)12(15)8-21(18,19)9-5-6-11(20-3)10(7-9)13(16)17/h5-7H,4,8H2,1-3H3,(H,16,17)